N-(1,3-benzodioxol-5-ylmethyl)-3-[2-(phenylmethyl)pyrrolidin-1-yl]carbonyl-benzenesulfonamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[2-(phenylmethyl)pyrrolidin-1-yl]carbonyl-benzenesulfonamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(2-benzylpyrrolidine-1-carbonyl)benzenesulfonamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[oxo-[2-(phenylmethyl)-1-pyrrolidinyl]methyl]benzenesulfonamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(2-benzylpyrrolidine-1-carbonyl)benzenesulfonamide Traditional Name: 3-(2-benzylpyrrolidine-1-carbonyl)-N-piperonyl-benzenesulfonamide Formula: C26H26N2O5S MolecularWeight: 478.56004

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2=CC(=CC=C2)S(=O)(=O)NCC3=CC4=C(C=C3)OCO4)CC5=CC=CC=C5

Isomeric SMILES

C1CC(N(C1)C(=O)C2=CC(=CC=C2)S(=O)(=O)NCC3=CC4=C(C=C3)OCO4)CC5=CC=CC=C5

InChI

InChI=1S/C26H26N2O5S/c29-26(28-13-5-9-22(28)14-19-6-2-1-3-7-19)21-8-4-10-23(16-21)34(30,31)27-17-20-11-12-24-25(15-20)33-18-32-24/h1-4,6-8,10-12,15-16,22,27H,5,9,13-14,17-18H2